IBS-ZINC02250574 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 1 0 0 0 0 0999 V2000 1.9590 -3.0770 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8640 -2.0090 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4390 -2.6510 0.0170 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 -1.8450 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 -0.6380 -0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8730 -2.4270 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9950 -1.5920 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2570 -2.1380 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4190 -3.5210 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3050 -4.3550 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0390 -3.8150 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6980 -4.0700 0.0450 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.9040 -3.2300 0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8610 -3.8950 1.1650 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.3540 -4.0320 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3040 -5.2580 0.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1200 -6.0100 0.2010 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.9060 -5.4350 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0460 -6.3620 -0.4240 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.6370 -7.5460 -0.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9710 -7.3550 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8500 -8.4510 0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0130 -8.3110 0.4310 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3340 -9.6700 -0.1960 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.9110 -10.4480 -0.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0560 -9.8430 -0.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6730 -10.9710 -0.8110 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1750 -8.8210 -0.7060 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7880 -9.0550 -1.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0070 -3.0620 1.3520 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9360 -2.5950 0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8620 -3.6860 0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8590 -3.7100 -0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9630 -1.3750 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9610 -1.3990 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8700 -0.5190 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1240 -1.4940 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4340 -5.4270 0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1750 -4.4630 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6240 -2.2420 0.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3900 -3.1400 -0.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8280 -5.8100 1.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9680 -5.1130 -0.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1740 -9.2400 -0.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7470 -9.9210 -1.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4140 -8.1780 -1.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8020 -2.1820 1.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 18 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 30 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 28 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 29 44 1 0 0 0 0 29 45 1 0 0 0 0 29 46 1 0 0 0 0 30 47 1 0 0 0 0 M END